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[3,6-bis(bromanyl)-4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl]methyl ethanoate

[3,6-bis(bromanyl)-4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl]methyl ethanoate

Systemtic Name:[3,6-bis(bromanyl)-4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl]methyl ethanoate
Openeye Name:(3,6-dibromo-4-hydroxy-5-oxo-cyclohepta-1,3,6-trien-1-yl)methyl acetate
CAS Name:acetic acid (3,6-dibromo-4-hydroxy-5-oxo-1-cyclohepta-1,3,6-trienyl)methyl ester
IUPAC Name:(3,6-dibromo-4-hydroxy-5-oxocyclohepta-1,3,6-trien-1-yl)methyl acetate
Traditional Name:acetic acid (3,6-dibromo-4-hydroxy-5-keto-cyclohepta-1,3,6-trien-1-yl)methyl ester
Formula: C10H8Br2O4
MolecularWeight: 351.97612
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC(=C(C(=O)C(=C1)Br)O)Br


Isomeric SMILES

CC(=O)OCC1=CC(=C(C(=O)C(=C1)Br)O)Br


InChI

InChI=1S/C10H8Br2O4/c1-5(13)16-4-6-2-7(11)9(14)10(15)8(12)3-6/h2-3H,4H2,1H3,(H,14,15)


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